1-((5-(2-nitrophenyl)furan-2-yl)methyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde | 1338233-12-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1-((5-(2-nitrophenyl)furan-2-yl)methyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde
• 英文别名: 1-[[5-(2-Nitrophenyl)furan-2-yl]methyl]-2,4-dioxopyrimidine-5-carbaldehyde
• CAS: 1338233-12-7
• 化学式: C₁₆H₁₁N₃O₆
• 分子量: 341.28
• InChiKey: SPIIZGFOUFBSOM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  25
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  125
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  1-((5-(2-nitrophenyl)furan-2-yl)methyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde 、 假硫代乙内酰脲 在 sodium acetate 作用下， 以 溶剂黄146 为溶剂， 反应 12.0h， 生成 (Z)-5-((2-imino-4-oxothiazolidin-5-ylidene)methyl)-1-((5-(2-nitrophenyl)furan-2-yl)methyl)pyrimidine-2,4(1H,3H)dione
  参考文献：
  名称：

  Synthesis and evaluation of compounds that induce readthrough of premature termination codons

  摘要：

  A structure-activity relationship (SAR) study was carried out to identify novel, small molecular weight compounds which induce readthrough of premature termination codons. In particular, analogs of RTC13, 1, were evaluated. In addition, hypothesizing that these compounds exhibit their activity by binding to the ribosome, we prepared the hybrid analogs 13 containing pyrimidine bases and these also showed good readthrough activity. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.07.107
• 作为产物：
  描述：

  5-(2-硝基苯)呋喃醛 在 sodium tetrahydroborate 、 三溴化磷 、 potassium carbonate 作用下， 以 乙醇 、 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 8.0h， 生成 1-((5-(2-nitrophenyl)furan-2-yl)methyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde
  参考文献：
  名称：

  Synthesis and evaluation of compounds that induce readthrough of premature termination codons

  摘要：

  A structure-activity relationship (SAR) study was carried out to identify novel, small molecular weight compounds which induce readthrough of premature termination codons. In particular, analogs of RTC13, 1, were evaluated. In addition, hypothesizing that these compounds exhibit their activity by binding to the ribosome, we prepared the hybrid analogs 13 containing pyrimidine bases and these also showed good readthrough activity. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.07.107

文献信息

• PREMATURE-TERMINATION-CODONS READTHROUGH COMPOUNDS
  申请人：GATTI Richard A.

  公开号：US20130274283A1

  公开（公告）日：2013-10-17

  Premature termination codons readthrough compounds, composition thereof, and methods of making and using the same are provided.

  提供了关于早期终止密码子读穿化合物、其组合物以及制备和使用方法的信息。
• US9255088B2
  申请人：——

  公开号：US9255088B2

  公开（公告）日：2016-02-09
• US9598395B2
  申请人：——

  公开号：US9598395B2

  公开（公告）日：2017-03-21
• [EN] PREMATURE-TERMINATION-CODONS READTHROUGH COMPOUNDS<br/>[FR] COMPOSÉS DE LECTURE ININTERROMPUE DE CODONS DE TERMINAISON PRÉMATURÉS (PTC)
  申请人：UNIV CALIFORNIA

  公开号：WO2012021707A2

  公开（公告）日：2012-02-16

  Premature termination codons readthrough compounds, composition thereof, and methods of making and using the same are provided.